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(Q105278611)
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English
5-Hydroxy-15-[2-(4-hydroxyphenyl)ethyl]-3,17,17-trimethyl-7-methylidene-15-azatricyclo[8.5.2.013,16]heptadeca-1(16),3-dien-14-one
group of stereoisomers with the chemical formula C₂₈H₃₇NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
verticillane diterpenoid
1 reference
inferred from
verticillane diterpenoid
phenethylamine alkaloid
1 reference
inferred from
phenethylamine alkaloid
mass
435.277344044
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₃₇NO₃
0 references
canonical SMILES
O=C1N(C2=C3C1CCC(CCC(=C)CC(O)C=C(C)C2)C3(C)C)CCC4=CC=C(O)C=C4
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Identifiers
InChI
InChI=1S/C28H37NO3/c1-18-5-8-21-9-12-24-26(28(21,3)4)25(17-19(2)16-23(31)15-18)29(27(24)32)14-13-20-6-10-22(30)11-7-20/h6-7,10-11,16,21,23-24,30-31H,1,5,8-9,12-15,17H2,2-4H3
0 references
InChIKey
USYVWERWVKDSSW-UHFFFAOYSA-N
0 references
PubChem CID
162890293
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
USYVWERWVKDSSW-UHFFFAOYSA-N
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